FAIRMol

Docking results

Sortable table and score distributions for docking results. The default view collapses poses to one best pose per ligand so decisions start from compounds, not pose duplicates.

DB SELECTION
Ligand priority Target report Viewer Experiments Reverse docking
534 ligands default: one best pose per compound ★ Native available
L. donovani rab5a · T22
L. donovani
Protein: Rab5a GTPase
Overall assessment for L. donovani rab5a
Promising A large fraction of ligands carry geometry or contact-quality warnings, so this target needs more caution.
Open target report
0Strong
6Promising
297Weak
231Reject
534/534SASA ready
Good signs: Excellent LE (-0.980 kcal/mol/HA) · Good fit quality (FQ -9.25) · Deep burial (91% SASA buried)
Watch-outs: High strain energy (22.4 kcal/mol) · No H-bonds detected · Geometry warnings
# Compound Alt poses Score ▲ Final rank Inter norm H-bonds Contacts Jaccard Contact recall HB recall HB role recall Assessment ↕
1 ulfkktlib_186
T22
 0 -27.434 0.4453 -1.0864 9 26 0.57 0.81 0.33 0.27 Reject
2 Z49575719
T22
 0 -32.170 0.6989 -1.1221 9 20 0.58 0.71 0.40 0.45 Reject
3 OSA_Lib_26
T22
 0 -29.308 0.8268 -0.9676 5 18 0.70 0.76 0.20 0.18 Weak
4 OSA_Lib_68
T22
 0 -29.502 1.0097 -1.0091 5 19 0.67 0.76 0.20 0.18 Reject
5 NMT-TY0616
T22
 0 -34.877 1.0821 -1.1588 13 21 0.40 0.57 0.33 0.36 Reject
6 Z19547115
T22
 0 -32.573 1.1692 -1.2022 7 19 0.90 0.90 0.40 0.45 Reject
7 OSA_Lib_5
T22
 0 -25.116 1.2054 -0.8880 1 21 0.62 0.76 0.00 0.00 Weak
8 TC408
T22
 0 -34.732 1.2690 -1.2066 8 25 0.77 0.95 0.40 0.45 Weak
9 ulfkktlib_1019
T22
 0 -26.601 1.2699 -1.0142 9 22 0.48 0.67 0.33 0.36 Reject
10 OSA_Lib_66
T22
 0 -30.844 1.2737 -0.9599 5 20 0.64 0.76 0.20 0.18 Reject
11 Z49547294
T22
 0 -33.655 1.3212 -1.6128 13 18 0.39 0.52 0.33 0.45 Reject
12 OHD_TC1_169
T22
 0 -25.068 1.3414 -1.3810 7 19 0.74 0.81 0.33 0.36 Weak
13 ulfkktlib_2561
T22
 0 -31.747 1.3545 -0.9851 6 24 0.67 0.86 0.33 0.36 Weak
14 OSA_Lib_1
T22
 0 -26.841 1.4196 -0.8122 1 18 0.44 0.57 0.07 0.09 Weak
15 KB_HAT_190
T22
 0 -30.240 1.4336 -1.1746 7 24 0.73 0.90 0.27 0.27 Weak
16 Z56784540
T22
 0 -35.334 1.5360 -1.0016 9 24 0.61 0.81 0.33 0.36 Reject
17 OSA_Lib_301
T22
 0 -29.576 1.5392 -0.9976 6 24 0.80 0.95 0.13 0.18 Reject
18 Z44296742
T22
 0 -27.975 1.6422 -1.1538 8 18 0.62 0.71 0.53 0.55 Reject
19 Z56781211
T22
 0 -32.330 1.6519 -1.1347 9 21 0.68 0.81 0.40 0.45 Reject
20 Z45956756
T22
 0 -24.631 1.6652 -1.5328 10 18 0.77 0.81 0.47 0.55 Weak
21 TC232
T22
 0 -28.658 1.6900 -1.0969 8 22 0.43 0.62 0.13 0.18 Reject
22 Z44089721
T22
 0 -29.376 1.6931 -1.4476 8 19 0.38 0.52 0.33 0.36 Weak
23 Z56935326
T22
 0 -31.098 1.7156 -0.8912 4 20 0.58 0.71 0.20 0.27 Weak
24 Z49558969
T22
 0 -26.090 1.7330 -1.2242 8 20 0.58 0.71 0.27 0.27 Weak
25 Z1501485351
T22
 0 -33.845 1.7331 -1.4312 11 21 0.83 0.90 0.47 0.45 Weak
26 NMT-TY0601
T22
 0 -33.966 1.7397 -1.1104 13 23 0.38 0.57 0.33 0.36 Reject
27 Z29149152
T22
 0 -29.927 1.7970 -1.2303 8 22 0.87 0.95 0.40 0.45 Weak
28 KB_HAT_174
T22
 0 -23.245 1.8145 -1.2074 6 20 0.58 0.71 0.33 0.36 Weak
29 KB_HAT_84
T22
 0 -33.089 1.8869 -1.0851 8 21 0.75 0.86 0.40 0.45 Weak
30 Z1537384907
T22
 0 -31.620 1.9087 -1.2628 6 19 0.54 0.67 0.33 0.36 Weak
31 Z1924722291
T22
 0 -28.855 1.9114 -0.9634 8 22 0.72 0.86 0.27 0.27 Weak
32 Z118508076
T22
 0 -40.071 1.9204 -1.3701 6 19 0.67 0.76 0.40 0.45 Weak
33 Z18509545
T22
 0 -28.965 1.9298 -1.0892 7 21 0.31 0.48 0.27 0.36 Reject
34 NMT-TY0959
T22
 0 -31.119 1.9773 -1.1336 10 21 0.62 0.76 0.13 0.18 Reject
35 Z49547615
T22
 0 -24.615 2.0077 -0.9887 9 17 0.36 0.48 0.33 0.36 Reject
36 Z18704485
T22
 0 -21.594 2.0237 -1.0753 11 24 0.80 0.95 0.47 0.45 Weak
37 OHD_TbNat_161
T22
 0 -31.686 2.0776 -1.0490 11 25 0.59 0.81 0.47 0.36 Weak
38 Z28346745
T22
 0 -40.375 2.0852 -1.0775 10 17 0.73 0.76 0.47 0.45 Weak
39 OHD_ACDS_29
T22
 0 -29.932 2.0970 -1.2124 7 19 0.82 0.86 0.33 0.36 Weak
40 Z443419884
T22
 0 -31.345 2.1081 -1.0510 8 21 0.68 0.81 0.47 0.55 Weak
41 OHD_TB2021_39
T22
 0 -27.464 2.1158 -1.3198 6 25 0.70 0.90 0.13 0.18 Reject
42 TC89
T22
 0 -34.165 2.1162 -1.0329 9 25 0.77 0.95 0.33 0.45 Weak
43 Z49615771
T22
 0 -31.200 2.1250 -1.6479 13 18 0.39 0.52 0.33 0.36 Weak
44 TC271
T22
 0 -28.752 2.1446 -1.4285 8 19 0.82 0.86 0.47 0.55 Weak
45 Z31271192
T22
 0 -31.554 2.1465 -1.1901 9 18 0.39 0.52 0.33 0.36 Weak
46 KB_HAT_8
T22
 0 -31.015 2.1508 -0.9679 11 24 0.55 0.76 0.27 0.36 Reject
47 Z24304592
T22
 0 -32.134 2.1636 -1.1569 11 20 0.58 0.71 0.40 0.45 Weak
48 OSA_Lib_14
T22
 0 -24.538 2.1785 -0.8463 1 23 0.57 0.76 0.00 0.00 Weak
49 OSA_Lib_209
T22
 0 -28.580 2.1916 -1.0349 7 17 0.52 0.62 0.27 0.27 Reject
50 ulfkktlib_165
T22
 0 -27.507 2.2079 -1.0367 7 26 0.62 0.86 0.07 0.09 Weak
51 ulfkktlib_1053
T22
 0 -33.321 2.2098 -1.6805 16 19 0.33 0.48 0.27 0.27 Weak
52 OSA_Lib_303
T22
 0 -29.783 2.2161 -1.0122 4 20 0.71 0.81 0.07 0.09 Weak
53 NMT-TY0575
T22
 0 -31.621 2.2192 -1.1531 13 22 0.39 0.57 0.33 0.36 Weak
54 Z49565795
T22
 0 -31.196 2.2198 -1.1333 5 21 0.62 0.76 0.27 0.27 Weak
55 Z96281652
T22
 0 -25.617 2.2390 -1.1838 6 19 0.67 0.76 0.40 0.36 Weak
56 TC324
T22
 0 -34.828 2.2654 -1.8252 12 20 0.86 0.90 0.40 0.36 Weak
57 Z28654532
T22
 0 -43.754 2.2752 -0.9835 8 23 0.57 0.76 0.40 0.36 Reject
58 OHD_Leishmania_481
T22
 0 -27.895 2.2763 -0.9514 5 20 0.64 0.76 0.13 0.09 Reject
59 Z55260483
T22
 0 -33.707 2.3059 -1.2572 12 15 0.50 0.57 0.47 0.45 Reject
60 Z56864520
T22
 0 -24.782 2.3297 -1.1209 13 14 0.40 0.48 0.47 0.45 Weak
61 OSA_Lib_120
T22
 0 -28.802 2.3490 -1.0018 7 17 0.52 0.62 0.27 0.27 Reject
62 Z19316134
T22
 0 -27.532 2.3536 -1.0429 10 22 0.65 0.81 0.40 0.36 Reject
63 Z56832742
T22
 0 -30.583 2.3607 -1.2469 10 21 0.91 0.95 0.47 0.45 Reject
64 MK178
T22
 0 -29.956 2.3627 -1.1807 6 23 0.83 0.95 0.27 0.18 Weak
65 NMT-TY0605
T22
 0 -33.097 2.3690 -1.1511 13 21 0.40 0.57 0.33 0.36 Weak
66 OSA_Lib_50
T22
 0 -30.778 2.3726 -0.8457 5 22 0.65 0.81 0.20 0.27 Reject
67 NMT-TY0624
T22
 0 -33.788 2.3851 -1.3038 14 22 0.72 0.86 0.33 0.36 Reject
68 Z56574044
T22
 0 -29.151 2.3884 -0.8738 12 21 0.68 0.81 0.47 0.55 Reject
69 Z46095617
T22
 0 -26.500 2.3932 -1.4545 10 18 0.50 0.62 0.33 0.36 Weak
70 Z44305068
T22
 0 -32.760 2.4016 -1.1587 11 14 0.52 0.57 0.47 0.45 Weak
71 OSA_Lib_316
T22
 0 -30.795 2.4078 -1.0957 5 22 0.65 0.81 0.07 0.09 Weak
72 Z68347974
T22
 0 -27.517 2.4137 -1.2707 11 18 0.62 0.71 0.47 0.45 Weak
73 KB_HAT_22
T22
 0 -30.000 2.4174 -1.1963 9 19 0.60 0.71 0.33 0.36 Promising
74 Z49724509
T22
 0 -28.004 2.4209 -1.2983 14 19 0.60 0.71 0.27 0.27 Weak
75 Z56775484
T22
 0 -32.429 2.4226 -1.2047 10 16 0.37 0.48 0.33 0.27 Reject
76 OSA_Lib_42
T22
 0 -19.546 2.4322 -0.9347 5 23 0.52 0.71 0.27 0.27 Reject
77 OSA_Lib_227
T22
 0 -26.551 2.4420 -0.8563 3 18 0.56 0.67 0.00 0.00 Reject
78 Z56882059
T22
 0 -36.140 2.4534 -1.1932 8 20 0.95 0.95 0.40 0.55 Weak
79 TC490
T22
 0 -28.778 2.4596 -1.1771 8 24 0.88 1.00 0.27 0.27 Weak
80 Z56765335
T22
 0 -27.862 2.4771 -1.1143 7 18 0.39 0.52 0.27 0.36 Reject
81 Z56857031
T22
 0 -35.049 2.4901 -1.5777 11 17 0.41 0.52 0.40 0.36 Weak
82 Z18754651
T22
 0 -31.211 2.5251 -1.3751 8 18 0.34 0.48 0.33 0.27 Weak
83 Z27867690
T22
 0 -26.098 2.5302 -1.0911 9 25 0.59 0.81 0.40 0.45 Weak
84 Z276200254
T22
 0 -28.139 2.5361 -1.1261 15 23 0.57 0.76 0.53 0.55 Reject
85 OHD_TB2021_32
T22
 0 -28.646 2.5587 -1.5357 10 20 0.95 0.95 0.40 0.55 Reject
86 OSA_Lib_99
T22
 0 -23.261 2.5912 -0.9079 7 20 0.46 0.62 0.33 0.36 Reject
87 Z56779856
T22
 0 -26.883 2.5981 -0.9943 12 20 0.64 0.76 0.40 0.45 Weak
88 OSA_Lib_224
T22
 0 -28.577 2.6026 -0.8066 5 22 0.65 0.81 0.20 0.27 Reject
89 TC322
T22
 0 -26.717 2.6028 -0.9948 8 25 0.70 0.90 0.33 0.45 Weak
90 OHD_TB2020_4
T22
 0 -27.315 2.6217 -0.6287 10 22 0.72 0.86 0.53 0.55 Reject
91 KB_chagas_222
T22
 0 -23.877 2.6318 -0.9810 8 18 0.56 0.67 0.47 0.45 Reject
92 OSA_Lib_98
T22
 0 -17.128 2.6392 -0.9005 6 24 0.50 0.71 0.27 0.27 Reject
93 NMT-TY0625
T22
 0 -33.606 2.6397 -1.2515 12 23 0.76 0.90 0.33 0.36 Reject
94 Z56911531
T22
 0 -33.050 2.6425 -1.5369 12 19 0.43 0.57 0.27 0.27 Reject
95 Z31474376
T22
 0 -30.749 2.6444 -1.1646 8 16 0.68 0.71 0.40 0.36 Weak
96 Z56833421
T22
 0 -27.522 2.6628 -1.2444 13 25 0.84 1.00 0.33 0.36 Reject
97 NMT-TY0410
T22
 0 -30.476 2.6633 -1.3802 15 17 0.58 0.67 0.47 0.45 Reject
98 Z166606608
T22
 0 -27.863 2.6661 -1.1670 7 18 0.39 0.52 0.27 0.27 Weak
99 Z55696460
T22
 0 -26.100 2.6730 -1.3796 11 19 0.67 0.76 0.53 0.64 Weak
100 NMT-TY0822
T22
 0 -29.268 2.6818 -1.6945 16 20 0.32 0.48 0.27 0.27 Weak
101 Z45872631
T22
 0 -31.303 2.6836 -1.3357 8 21 0.62 0.76 0.40 0.45 Weak
102 KB_HAT_14
T22
 0 -28.996 2.6838 -1.1624 9 20 0.86 0.90 0.33 0.36 Weak
103 Z44852102
T22
 0 -30.132 2.6883 -1.2497 10 22 0.87 0.95 0.40 0.45 Weak
104 Z314612464
T22
 0 -29.034 2.6917 -1.3959 6 18 0.50 0.62 0.40 0.45 Weak
105 OHD_TC1_88
T22
 0 -27.327 2.7001 -1.3543 8 19 0.54 0.67 0.27 0.27 Weak
106 Z57100312
T22
 0 -29.189 2.7109 -1.3401 8 18 0.62 0.71 0.40 0.45 Weak
107 KB_Leish_40
T22
 0 -38.071 2.7271 -1.2073 8 24 0.73 0.90 0.20 0.18 Weak
108 OSA_Lib_88
T22
 0 -32.251 2.7376 -0.8994 5 22 0.65 0.81 0.20 0.27 Weak
109 Z237995644
T22
 0 -27.931 2.7382 -1.0373 6 24 0.73 0.90 0.33 0.36 Weak
110 Z29406212
T22
 0 -31.862 2.7470 -1.4214 7 18 0.50 0.62 0.40 0.45 Weak
111 Z19352754
T22
 0 -31.834 2.7504 -1.1322 10 20 0.64 0.76 0.40 0.45 Weak
112 MK212
T22
 0 -23.196 2.7554 -1.0057 11 23 0.91 1.00 0.47 0.45 Weak
113 TC342
T22
 0 -20.991 2.7578 -0.8276 7 22 0.59 0.76 0.27 0.36 Reject
114 OSA_Lib_41
T22
 0 -23.537 2.7714 -0.8921 5 21 0.50 0.67 0.27 0.27 Reject
115 Z31759534
T22
 0 -23.560 2.7846 -1.0958 10 19 0.67 0.76 0.40 0.36 Reject
116 Z1213740102
T22
 0 -31.395 2.7864 -0.9320 7 21 0.62 0.76 0.33 0.36 Reject
117 Z104500108
T22
 0 -24.004 2.7887 -1.1557 12 23 0.83 0.95 0.47 0.55 Weak
118 NMT-TY0621
T22
 0 -31.896 2.7968 -1.1106 15 21 0.40 0.57 0.33 0.36 Weak
119 MK215
T22
 0 -28.154 2.7969 -1.0381 16 17 0.52 0.62 0.40 0.36 Weak
120 OHD_TB2021_75
T22
 0 -25.959 2.8078 -1.1043 7 18 0.70 0.76 0.33 0.36 Weak
121 Z26848572
T22
 0 -29.674 2.8143 -1.0256 6 20 0.41 0.57 0.33 0.36 Weak
122 Z56811592
T22
 0 -31.572 2.8200 -1.2495 13 19 0.38 0.52 0.60 0.55 Weak
123 OSA_Lib_131
T22
 0 -29.954 2.8214 -0.8945 3 24 0.61 0.81 0.07 0.09 Weak
124 OSA_Lib_37
T22
 0 -15.469 2.8220 -0.9343 11 23 0.52 0.71 0.40 0.36 Reject
125 NMT-TY0606
T22
 0 -31.805 2.8232 -1.2636 14 17 0.65 0.71 0.40 0.36 Reject
126 Z195195302
T22
 0 -32.230 2.8331 -1.2933 13 23 0.63 0.81 0.40 0.45 Weak
127 Z45874785
T22
 0 -31.019 2.8419 -1.1217 6 24 0.61 0.81 0.27 0.27 Weak
128 Z57783660
T22
 0 -31.794 2.8455 -0.9995 10 18 0.56 0.67 0.47 0.45 Reject
129 Z26825047
T22
 0 -26.375 2.8588 -1.0766 10 21 0.68 0.81 0.40 0.45 Weak
130 Z49734016
T22
 0 -28.481 2.8693 -1.1405 7 22 0.65 0.81 0.33 0.45 Reject
131 OSA_Lib_35
T22
 0 -13.288 2.8779 -0.9869 7 21 0.50 0.67 0.27 0.27 Reject
132 Z108563960
T22
 0 -35.089 2.8977 -1.2818 6 20 0.37 0.52 0.33 0.36 Weak
133 OSA_Lib_97
T22
 0 -23.400 2.8986 -0.8954 7 21 0.50 0.67 0.33 0.36 Reject
134 OSA_Lib_38
T22
 0 -22.228 2.8997 -1.0167 7 22 0.48 0.67 0.27 0.27 Reject
135 OHD_Leishmania_191
T22
 0 -16.611 2.9079 -1.1583 14 22 0.65 0.81 0.53 0.55 Weak
136 KB_chagas_176
T22
 0 -23.180 2.9080 -1.0026 6 18 0.44 0.57 0.33 0.27 Weak
137 Z24541677
T22
 0 -31.464 2.9115 -1.1910 11 21 0.62 0.76 0.40 0.45 Weak
138 OSA_Lib_100
T22
 0 -19.923 2.9137 -0.9690 6 21 0.45 0.62 0.27 0.27 Reject
139 Z56811143
T22
 0 -31.503 2.9209 -1.1721 10 25 0.77 0.95 0.33 0.36 Weak
140 OSA_Lib_223
T22
 0 -28.727 2.9240 -0.8244 4 22 0.59 0.76 0.13 0.18 Reject
141 OHD_TB2024_11
T22
 2
3 total
 -31.594 2.9443 -1.0967 5 27 0.71 0.95 0.27 0.27 Reject
142 OHD_TC1_170
T22
 0 -25.768 2.9508 -1.4399 13 20 0.64 0.76 0.40 0.45 Weak
143 TC345
T22
 0 -31.667 2.9555 -2.1134 13 16 0.42 0.52 0.33 0.36 Promising
144 TC410
T22
 0 -28.677 2.9638 -1.2406 16 24 0.80 0.95 0.53 0.45 Promising
145 ulfkktlib_2298
T22
 0 -22.910 2.9653 -1.0806 12 20 0.58 0.71 0.40 0.64 Weak
146 Z24314825
T22
 0 -32.593 2.9738 -1.1150 11 18 0.62 0.71 0.40 0.45 Weak
147 Z49638306
T22
 0 -31.299 2.9838 -1.1511 12 22 0.87 0.95 0.53 0.64 Weak
148 KB_chagas_42
T22
 0 -34.034 2.9871 -1.1890 9 26 0.68 0.90 0.40 0.36 Reject
149 OHD_TC1_221
T22
 0 -29.241 2.9948 -0.9583 7 21 0.75 0.86 0.33 0.36 Weak
150 ulfkktlib_404
T22
 0 -28.982 2.9967 -1.3240 11 19 0.48 0.62 0.40 0.36 Weak
151 Z16588308
T22
 0 -30.087 3.0005 -1.1989 13 15 0.38 0.48 0.40 0.36 Weak
152 NMT-TY0569
T22
 0 -29.439 3.0034 -1.3992 16 19 0.38 0.52 0.33 0.27 Weak
153 Z33269755
T22
 0 -30.926 3.0107 -1.0098 13 25 0.77 0.95 0.47 0.55 Reject
154 Z2418739356
T22
 0 -27.094 3.0197 -1.5280 13 17 0.31 0.43 0.40 0.36 Weak
155 OHD_TB2021_35
T22
 0 -29.429 3.0373 -1.6924 12 19 0.82 0.86 0.60 0.73 Weak
156 KB_chagas_128
T22
 0 -28.305 3.0387 -0.9311 11 21 0.75 0.86 0.60 0.64 Weak
157 NMT-TY0612
T22
 0 -31.475 3.0401 -0.9881 14 24 0.41 0.62 0.33 0.36 Reject
158 Z30857987
T22
 0 -33.393 3.0587 -1.4892 10 21 0.91 0.95 0.47 0.45 Weak
159 Z56841578
T22
 0 -29.115 3.0608 -1.6011 7 18 0.86 0.86 0.40 0.36 Weak
160 KB_chagas_79
T22
 0 -32.140 3.0610 -0.9171 10 17 0.73 0.76 0.47 0.55 Reject
161 OHD_TB2021_37
T22
 0 -27.238 3.0648 -1.1194 6 20 0.64 0.76 0.27 0.27 Weak
162 Z56932065
T22
 0 -30.424 3.0882 -1.3552 12 19 0.43 0.57 0.27 0.27 Reject
163 NMT-TY0254
T22
 0 -31.675 3.0953 -2.2858 15 17 0.31 0.43 0.40 0.36 Weak
164 Z45692840
T22
 0 -27.560 3.1179 -1.4445 6 18 0.34 0.48 0.33 0.36 Weak
165 Z45875055
T22
 0 -31.989 3.1230 -1.1165 7 24 0.61 0.81 0.33 0.36 Weak
166 Z31183768
T22
 0 -30.771 3.1237 -1.0356 8 19 0.38 0.52 0.47 0.36 Reject
167 Z25218329
T22
 0 -18.565 3.1279 -1.0785 15 19 0.67 0.76 0.40 0.45 Reject
168 Z56831485
T22
 0 -29.605 3.1280 -1.1906 9 21 0.75 0.86 0.40 0.36 Reject
169 Z1541815088
T22
 0 -25.276 3.1300 -1.4577 11 17 0.27 0.38 0.33 0.27 Weak
170 Z23213151
T22
 0 -29.327 3.1419 -1.2439 9 22 0.65 0.81 0.47 0.55 Weak
171 TC323
T22
 0 -35.225 3.1444 -1.9351 12 19 0.74 0.81 0.47 0.45 Weak
172 Z49633576
T22
 0 -33.536 3.1472 -1.2325 14 23 0.76 0.90 0.67 0.73 Reject
173 OHD_TC1_185
T22
 0 -26.896 3.1645 -1.3803 16 22 0.43 0.62 0.47 0.45 Reject
174 TC359
T22
 1
2 total
 -28.849 3.1650 -1.2712 8 23 0.69 0.86 0.27 0.27 Reject
175 OHD_Leishmania_482
T22
 0 -24.306 3.1678 -0.9877 14 25 0.53 0.76 0.07 0.09 Weak
176 Z115639124
T22
 0 -28.573 3.1763 -1.5911 8 18 0.50 0.62 0.40 0.45 Weak
177 Z56261632
T22
 0 -35.084 3.1764 -1.5026 13 22 0.79 0.90 0.47 0.45 Weak
178 Z53223394
T22
 0 -29.890 3.1797 -1.5344 10 16 0.68 0.71 0.40 0.36 Promising
179 Z241739672
T22
 0 -32.629 3.1855 -1.2975 4 24 0.67 0.86 0.27 0.27 Weak
180 Z45900933
T22
 0 -29.918 3.1882 -1.2120 7 22 0.43 0.62 0.33 0.36 Weak
181 Z44831771
T22
 0 -26.665 3.2066 -1.0390 14 22 0.72 0.86 0.53 0.64 Weak
182 OHD_TB2021_33
T22
 0 -28.750 3.2129 -1.1161 10 18 0.44 0.57 0.40 0.45 Reject
183 Z1213671973
T22
 0 -19.903 3.2130 -0.8978 8 19 0.67 0.76 0.40 0.45 Weak
184 Z56569637
T22
 0 -32.912 3.2236 -0.8526 9 21 0.68 0.81 0.53 0.55 Reject
185 Z30564216
T22
 0 -27.725 3.2271 -1.4427 10 21 0.50 0.67 0.40 0.36 Weak
186 Z30882487
T22
 0 -30.451 3.2390 -0.9663 10 23 0.83 0.95 0.47 0.45 Reject
187 CKP-35
T22
 0 -29.020 3.2508 -1.7641 9 16 0.42 0.52 0.27 0.27 Weak
188 Z56821783
T22
 0 -34.622 3.2525 -1.5903 11 18 0.50 0.62 0.40 0.36 Weak
189 Z286182030
T22
 0 -30.522 3.2653 -1.4800 9 19 0.82 0.86 0.40 0.45 Reject
190 Z19455379
T22
 0 -26.839 3.2742 -1.3024 11 18 0.56 0.67 0.40 0.45 Promising
191 Z89541367
T22
 0 -28.846 3.2745 -1.1112 11 19 0.38 0.52 0.27 0.27 Weak
192 Z54323248
T22
 0 -27.340 3.2764 -1.0808 8 19 0.54 0.67 0.40 0.45 Reject
193 Z73762419
T22
 0 -30.886 3.2807 -1.1588 10 19 0.67 0.76 0.40 0.36 Weak
194 KB_HAT_152
T22
 0 -29.564 3.2810 -0.9118 8 22 0.72 0.86 0.27 0.27 Weak
195 TC227
T22
 0 -31.878 3.2904 -0.8837 9 18 0.62 0.71 0.13 0.18 Reject
196 Z56849557
T22
 0 -27.584 3.2974 -0.9854 12 21 0.75 0.86 0.47 0.45 Reject
197 Z49605089
T22
 0 -33.240 3.3000 -1.2095 11 19 0.60 0.71 0.53 0.55 Weak
198 MK218
T22
 0 -27.139 3.3045 -1.1310 13 24 0.88 1.00 0.47 0.45 Weak
199 OSA_Lib_86
T22
 0 -19.401 3.3070 -0.8245 7 23 0.52 0.71 0.27 0.27 Reject
200 OHD_MAC_34
T22
 0 -29.672 3.3251 -1.0494 8 17 0.65 0.71 0.33 0.36 Reject
201 NMT-TY0565
T22
 0 -30.723 3.3258 -1.6780 16 19 0.38 0.52 0.27 0.27 Weak
202 Z16382399
T22
 0 -32.020 3.3462 -1.0915 8 19 0.82 0.86 0.40 0.36 Reject
203 Z49613286
T22
 0 -37.806 3.3508 -1.3111 16 21 0.35 0.52 0.40 0.45 Reject
204 ulfkktlib_1360
T22
 0 -27.313 3.3514 -0.9783 10 24 0.73 0.90 0.40 0.36 Weak
205 NMT-TY0547
T22
 0 -28.704 3.3593 -1.4021 16 20 0.41 0.57 0.33 0.36 Weak
206 Z25221644
T22
 0 -31.280 3.3626 -1.0226 9 21 0.35 0.52 0.27 0.27 Weak
207 OHD_TB2021_76
T22
 0 -25.761 3.3708 -1.3162 6 17 0.46 0.57 0.20 0.18 Weak
208 OHD_MAC_28
T22
 0 -27.223 3.3806 -1.0258 8 17 0.73 0.76 0.33 0.36 Reject
209 OSA_Lib_91
T22
 0 -24.066 3.3932 -0.9081 6 18 0.39 0.52 0.27 0.27 Reject
210 Z29084466
T22
 0 -29.673 3.3936 -1.1892 8 19 0.67 0.76 0.47 0.64 Weak
211 Z56835260
T22
 0 -27.669 3.3974 -1.3177 4 20 0.37 0.52 0.27 0.27 Weak
212 TC287
T22
 0 -29.698 3.3999 -1.8555 13 17 0.27 0.38 0.27 0.27 Weak
213 KB_HAT_11
T22
 0 -27.206 3.4191 -1.0440 8 21 0.68 0.81 0.53 0.45 Weak
214 NMT-TY0920
T22
 0 -30.367 3.4279 -1.2440 11 26 0.74 0.95 0.33 0.36 Reject
215 Z30932242
T22
 0 -29.759 3.4317 -1.2808 12 18 0.62 0.71 0.40 0.36 Weak
216 Z30858102
T22
 0 -37.048 3.4329 -1.5933 12 21 0.91 0.95 0.47 0.45 Weak
217 NMT-TY0824
T22
 0 -27.623 3.4354 -1.6822 14 18 0.34 0.48 0.27 0.27 Weak
218 KB_HAT_151
T22
 0 -26.709 3.4532 -0.9411 10 22 0.72 0.86 0.27 0.27 Weak
219 Z2417557127
T22
 0 -27.623 3.4594 -1.0568 11 19 0.82 0.86 0.40 0.45 Weak
220 Z45537946
T22
 0 -33.245 3.4621 -1.5542 8 20 0.86 0.90 0.40 0.36 Weak
221 Z57392960
T22
 0 -33.552 3.4768 -1.2819 9 22 0.65 0.81 0.40 0.36 Weak
222 Z56327358
T22
 0 -29.171 3.4780 -0.9755 9 20 0.71 0.81 0.40 0.45 Reject
223 Z30488659
T22
 0 -25.684 3.4798 -1.0821 11 24 0.73 0.90 0.40 0.45 Weak
224 KB_Leish_139
T22
 0 -27.303 3.5035 -1.0112 4 21 0.83 0.90 0.27 0.27 Reject
225 KB_HAT_182
T22
 0 -32.092 3.5038 -1.2640 10 21 0.91 0.95 0.53 0.64 Weak
226 OHD_Leishmania_136
T22
 0 -30.348 3.5056 -1.0687 8 19 0.60 0.71 0.33 0.36 Weak
227 NMT-TY0779
T22
 0 -30.738 3.5134 -1.3437 11 19 0.48 0.62 0.47 0.55 Reject
228 ulfkktlib_2878
T22
 0 -33.531 3.5239 -1.4070 9 20 0.64 0.76 0.33 0.36 Weak
229 NMT-TY0564
T22
 0 -32.351 3.5289 -1.5003 16 19 0.38 0.52 0.33 0.36 Weak
230 Z28905104
T22
 0 -25.934 3.5296 -1.1275 8 24 0.73 0.90 0.40 0.45 Weak
231 NMT-TY0974
T22
 0 -31.674 3.5511 -1.4005 10 19 0.48 0.62 0.53 0.55 Weak
232 Z275024592
T22
 0 -31.144 3.5537 -1.0542 10 19 0.67 0.76 0.47 0.45 Weak
233 NMT-TY0577
T22
 0 -33.591 3.5581 -1.3346 16 20 0.37 0.52 0.40 0.45 Weak
234 Z68347375
T22
 0 -34.474 3.5854 -1.0705 7 21 0.75 0.86 0.27 0.27 Reject
235 Z45537933
T22
 0 -31.788 3.5922 -1.5400 11 18 0.70 0.76 0.47 0.45 Weak
236 GemmaOHDUnisi_5
T22
 0 -29.218 3.5960 -1.1138 12 22 0.65 0.81 0.53 0.45 Reject
237 ulfkktlib_3457
T22
 0 -32.138 3.5993 -1.5090 11 23 0.69 0.86 0.47 0.55 Promising
238 Z27681463
T22
 0 -30.328 3.6179 -1.0818 9 15 0.64 0.67 0.47 0.45 Reject
239 NMT-TY0833
T22
 0 -32.868 3.6267 -1.3962 16 16 0.61 0.67 0.40 0.36 Reject
240 Z32448862
T22
 0 -22.454 3.6281 -1.1919 11 20 0.78 0.86 0.47 0.45 Reject
241 TC72
T22
 0 -32.943 3.6380 -0.8935 10 20 0.95 0.95 0.40 0.36 Reject
242 ulfkktlib_1417
T22
 0 -31.033 3.6432 -2.3374 16 18 0.30 0.43 0.27 0.27 Weak
243 OHD_TB2021_21
T22
 0 -29.980 3.6485 -1.2829 10 24 0.61 0.81 0.40 0.55 Reject
244 Z57906432
T22
 0 -29.343 3.6784 -1.2049 9 14 0.59 0.62 0.40 0.36 Weak
245 OSA_Lib_198
T22
 0 -24.153 3.6898 -0.9583 6 22 0.65 0.81 0.20 0.18 Reject
246 KB_HAT_181
T22
 0 -32.428 3.6943 -1.3215 13 23 0.83 0.95 0.67 0.82 Weak
247 Z426041342
T22
 0 -27.438 3.6973 -1.1685 8 22 0.65 0.81 0.33 0.27 Weak
248 OHD_Leishmania_131
T22
 0 -21.976 3.7018 -1.0736 9 19 0.82 0.86 0.40 0.45 Reject
249 Z20127922
T22
 0 -32.156 3.7035 -0.9232 6 23 0.69 0.86 0.40 0.45 Reject
250 Z27682886
T22
 0 -30.359 3.7065 -1.4640 10 18 0.77 0.81 0.40 0.36 Weak
251 OSA_Lib_40
T22
 0 -18.436 3.7107 -0.9599 11 22 0.48 0.67 0.40 0.36 Reject
252 Z124328460
T22
 0 -29.574 3.7132 -1.3584 9 19 0.82 0.86 0.40 0.36 Weak
253 Z49597668
T22
 0 -28.785 3.7226 -1.1064 11 22 0.79 0.90 0.47 0.55 Weak
254 MK7
T22
 0 -25.221 3.7256 -1.1188 11 19 0.54 0.67 0.13 0.18 Weak
255 Z31413736
T22
 0 -26.742 3.7355 -1.4208 11 21 0.75 0.86 0.40 0.45 Weak
256 Z27677175
T22
 0 -24.285 3.7431 -1.0387 11 19 0.67 0.76 0.33 0.36 Weak
257 Z20224548
T22
 0 -29.935 3.7533 -1.0002 13 22 0.59 0.76 0.33 0.45 Weak
258 Z426369012
T22
 0 -33.098 3.7550 -1.0927 16 20 0.58 0.71 0.40 0.45 Weak
259 OHD_MAC_74
T22
 0 -25.777 3.7567 -1.0199 9 19 0.82 0.86 0.33 0.36 Reject
260 Z16403525
T22
 0 -26.385 3.7635 -1.0761 10 26 0.68 0.90 0.47 0.45 Weak
261 ulfkktlib_339
T22
 0 -25.346 3.7636 -1.5316 16 19 0.54 0.67 0.40 0.45 Weak
262 OSA_Lib_56
T22
 0 -25.609 3.7794 -0.7903 4 21 0.68 0.81 0.07 0.09 Reject
263 Z33598736
T22
 0 -32.807 3.7799 -1.1926 10 19 0.67 0.76 0.47 0.45 Reject
264 OSA_Lib_92
T22
 0 -23.110 3.7805 -1.0239 7 22 0.48 0.67 0.27 0.27 Reject
265 Z19138088
T22
 0 -27.538 3.7807 -0.9795 10 15 0.64 0.67 0.53 0.64 Weak
266 Z56821211
T22
 0 -29.872 3.7830 -1.3351 12 23 0.91 1.00 0.47 0.55 Weak
267 OSA_Lib_39
T22
 0 -22.135 3.7860 -0.8950 7 20 0.46 0.62 0.33 0.36 Weak
268 Z55294982
T22
 0 -31.682 3.7896 -1.1326 9 19 0.67 0.76 0.40 0.45 Weak
269 OHD_TB2020_10
T22
 0 -35.512 3.7980 -1.1289 7 22 0.34 0.52 0.40 0.36 Weak
270 Z25103234
T22
 0 -29.193 3.8016 -1.5005 8 16 0.61 0.67 0.40 0.36 Weak
271 KB_chagas_108
T22
 0 -29.837 3.8042 -0.8822 5 18 0.77 0.81 0.33 0.36 Weak
272 MK175
T22
 0 -32.209 3.8087 -1.4014 12 21 0.91 0.95 0.53 0.55 Weak
273 Z1521553597
T22
 0 -32.340 3.8126 -1.1061 7 23 0.69 0.86 0.33 0.36 Weak
274 Z1501480428
T22
 0 -29.870 3.8164 -1.0416 6 22 0.72 0.86 0.27 0.27 Weak
275 Z57728545
T22
 0 -27.674 3.8213 -1.4527 16 19 0.33 0.48 0.33 0.27 Reject
276 OHD_TC1_163
T22
 0 -25.396 3.8216 -1.1951 16 19 0.33 0.48 0.33 0.36 Weak
277 OSA_Lib_107
T22
 0 -15.559 3.8323 -0.9573 7 19 0.54 0.67 0.33 0.27 Reject
278 Z31545384
T22
 0 -29.952 3.8387 -1.0575 10 23 0.57 0.76 0.40 0.45 Reject
279 KB_Leish_46
T22
 0 -28.255 3.8403 -1.0203 6 20 0.71 0.81 0.33 0.36 Reject
280 NMT-TY0408
T22
 0 -29.361 3.8532 -1.3731 16 19 0.38 0.52 0.47 0.45 Reject
281 Z56782307
T22
 0 -30.768 3.8564 -1.0373 11 17 0.41 0.52 0.40 0.45 Reject
282 OHD_MAC_67
T22
 0 -27.655 3.8730 -0.9239 9 15 0.57 0.62 0.20 0.36 Reject
283 OSA_Lib_31
T22
 0 -15.845 3.8776 -1.0186 7 21 0.50 0.67 0.27 0.27 Reject
284 Z57300837
T22
 0 -29.112 3.8782 -1.2091 10 20 0.41 0.57 0.40 0.36 Weak
285 KB_chagas_93
T22
 0 -33.804 3.8890 -1.0943 10 22 0.72 0.86 0.40 0.36 Weak
286 Z56902329
T22
 0 -34.086 3.8893 -1.3315 12 20 0.41 0.57 0.27 0.27 Reject
287 NMT-TY0915
T22
 0 -30.327 3.8953 -1.6195 11 17 0.46 0.57 0.47 0.55 Weak
288 Z14342059
T22
 0 -28.078 3.9088 -0.9686 9 22 0.65 0.81 0.33 0.36 Weak
289 Z1546616194
T22
 0 -33.331 3.9117 -1.6429 11 15 0.44 0.52 0.40 0.36 Weak
290 KB_chagas_54
T22
 0 -28.798 3.9150 -1.2163 6 22 0.79 0.90 0.27 0.27 Weak
291 Z44831334
T22
 0 -32.861 3.9193 -1.3088 14 25 0.64 0.86 0.47 0.64 Reject
292 Z56808903
T22
 0 -28.847 3.9321 -1.0011 9 17 0.46 0.57 0.27 0.36 Reject
293 Z133716394
T22
 0 -34.294 3.9368 -1.6330 11 21 0.83 0.90 0.47 0.45 Weak
294 KB_chagas_26
T22
 0 -26.524 3.9391 -1.2573 8 20 0.86 0.90 0.40 0.45 Weak
295 OHD_MAC_3
T22
 0 -30.616 3.9446 -0.8226 13 19 0.54 0.67 0.27 0.36 Reject
296 Z49558975
T22
 0 -30.618 3.9477 -1.3511 11 20 0.86 0.90 0.33 0.36 Weak
297 Z49620451
T22
 0 -29.941 3.9528 -1.2311 14 18 0.62 0.71 0.47 0.55 Reject
298 OSA_Lib_54
T22
 0 -19.522 3.9721 -1.1568 10 19 0.48 0.62 0.33 0.27 Reject
299 Z31408577
T22
 0 -28.867 3.9769 -1.1377 12 17 0.31 0.43 0.40 0.36 Weak
300 Z56071437
T22
 0 -33.224 3.9872 -1.0836 13 19 0.67 0.76 0.40 0.45 Reject
301 Z56832020
T22
 0 -29.950 3.9921 -1.2151 9 21 0.35 0.52 0.40 0.36 Weak
302 Z57783661
T22
 0 -32.974 3.9931 -1.0436 8 19 0.43 0.57 0.40 0.45 Reject
303 Z33448659
T22
 0 -33.632 3.9945 -1.2259 10 23 0.83 0.95 0.40 0.36 Reject
304 MK179
T22
 0 -34.547 3.9958 -1.2232 13 21 0.68 0.81 0.40 0.45 Reject
305 Z56849599
T22
 0 -28.939 3.9993 -1.2216 10 19 0.43 0.57 0.40 0.36 Weak
306 Z116369884
T22
 0 -32.843 4.0086 -2.2910 12 15 0.64 0.67 0.40 0.36 Weak
307 NMT-TY1002
T22
 0 -28.849 4.0102 -1.3166 9 21 0.56 0.71 0.47 0.45 Weak
308 NMT-TY0919
T22
 0 -32.130 4.0117 -1.2492 10 21 0.56 0.71 0.47 0.45 Weak
309 KB_Leish_20
T22
 0 -21.537 4.0168 -1.0464 9 20 0.52 0.67 0.40 0.45 Reject
310 Z95963339
T22
 0 -24.843 4.0238 -1.0719 9 17 0.36 0.48 0.33 0.27 Weak
311 OSA_Lib_240
T22
 0 -29.387 4.0276 -0.8900 6 18 0.77 0.81 0.07 0.09 Reject
312 ulfkktlib_439
T22
 0 -29.276 4.0277 -0.9387 6 25 0.70 0.90 0.27 0.27 Reject
313 KB_chagas_101
T22
 0 -34.414 4.0318 -1.2085 13 22 0.95 1.00 0.47 0.55 Weak
314 KB_HAT_115
T22
 0 -24.661 4.0338 -1.0544 6 20 0.86 0.90 0.33 0.36 Weak
315 Z1939360435
T22
 0 -30.448 4.0392 -1.1211 6 20 0.58 0.71 0.33 0.36 Weak
316 KB_chagas_102
T22
 0 -23.416 4.0533 -0.9900 7 20 0.86 0.90 0.47 0.45 Weak
317 KB_HAT_167
T22
 0 -30.751 4.0549 -1.4931 10 22 0.95 1.00 0.47 0.45 Reject
318 KB_chagas_146
T22
 0 -26.546 4.0605 -1.0392 10 23 0.76 0.90 0.53 0.55 Weak
319 OHD_TB2020_7
T22
 0 -29.221 4.0638 -1.0876 9 23 0.47 0.67 0.40 0.36 Reject
320 ulfkktlib_2474
T22
 0 -28.823 4.0695 -0.8961 9 18 0.44 0.57 0.40 0.36 Weak
321 ulfkktlib_626
T22
 0 -29.505 4.0724 -1.4455 11 15 0.64 0.67 0.47 0.45 Weak
322 OHD_MAC_75
T22
 0 -26.888 4.0852 -1.1124 10 23 0.83 0.95 0.33 0.36 Reject
323 KB_chagas_21
T22
 2
3 total
 -23.555 4.0915 -1.0064 13 21 0.62 0.76 0.60 0.64 Reject
324 Z87656593
T22
 0 -34.624 4.0948 -1.3078 10 22 0.87 0.95 0.47 0.45 Weak
325 OHD_Babesia_16
T22
 0 -32.883 4.1005 -0.9350 8 21 0.68 0.81 0.13 0.18 Reject
326 Z56826892
T22
 0 -31.848 4.1042 -1.0664 11 23 0.76 0.90 0.47 0.45 Reject
327 Z57009636
T22
 0 -29.419 4.1059 -1.3993 12 18 0.70 0.76 0.33 0.36 Weak
328 Z71577027
T22
 0 -31.281 4.1102 -1.1569 12 17 0.73 0.76 0.53 0.55 Weak
329 Z19129319
T22
 0 -39.385 4.1104 -1.0935 6 23 0.63 0.81 0.33 0.36 Reject
330 GemmaOHDUnisi_36
T22
 0 -26.581 4.1210 -1.0607 8 21 0.50 0.67 0.20 0.27 Weak
331 Z30000990
T22
 0 -33.595 4.1255 -0.9198 10 19 0.67 0.76 0.47 0.45 Weak
332 Z29673175
T22
 0 -41.476 4.1273 -1.4900 11 19 0.67 0.76 0.40 0.55 Weak
333 KB_Leish_29
T22
 0 -28.106 4.1320 -1.2022 7 21 0.91 0.95 0.40 0.36 Weak
334 Z17094078
T22
 0 -23.170 4.1366 -1.1343 16 23 0.83 0.95 0.67 0.73 Weak
335 OHD_TB2022_32
T22
 0 -37.909 4.1725 -1.4993 16 21 0.83 0.90 0.60 0.64 Reject
336 OSA_Lib_29
T22
 0 -21.565 4.1726 -1.0153 7 22 0.48 0.67 0.27 0.27 Reject
337 Z29502201
T22
 0 -35.547 4.1738 -1.2561 9 18 0.44 0.57 0.40 0.45 Reject
338 Z31082948
T22
 0 -31.939 4.1872 -1.2058 6 17 0.46 0.57 0.27 0.27 Weak
339 Z56905026
T22
 0 -33.171 4.1996 -1.3253 12 19 0.48 0.62 0.33 0.36 Reject
340 Z223826364
T22
 0 -31.131 4.2065 -1.2256 12 17 0.65 0.71 0.47 0.45 Weak
341 Z28624207
T22
 0 -27.142 4.2073 -0.8713 11 21 0.75 0.86 0.40 0.55 Reject
342 Z275022778
T22
 0 -34.691 4.2123 -1.1632 10 20 0.64 0.76 0.40 0.36 Weak
343 MK169
T22
 0 -29.907 4.2135 -1.2068 12 21 0.83 0.90 0.60 0.64 Weak
344 Z56785257
T22
 0 -30.876 4.2265 -0.8466 9 20 0.78 0.86 0.40 0.36 Reject
345 Z56174576
T22
 0 -27.041 4.2285 -1.1666 10 19 0.38 0.52 0.40 0.36 Weak
346 Z68563450
T22
 0 -22.228 4.2287 -0.9814 7 26 0.68 0.90 0.33 0.36 Reject
347 Z57514570
T22
 0 -28.930 4.2355 -1.0185 6 19 0.90 0.90 0.33 0.36 Reject
348 Z19673935
T22
 0 -18.151 4.2363 -1.3001 11 20 0.46 0.62 0.27 0.27 Weak
349 NMT-TY0541
T22
 0 -27.612 4.2473 -1.4783 16 23 0.42 0.62 0.27 0.27 Reject
350 NMT-TY0921
T22
 0 -26.817 4.2489 -1.3149 9 23 0.57 0.76 0.47 0.45 Weak
351 OHD_TB2022_12
T22
 0 -30.905 4.2592 -0.8230 6 26 0.57 0.81 0.33 0.36 Weak
352 OHD_TB2020_8
T22
 0 -34.460 4.2636 -1.0851 6 26 0.62 0.86 0.27 0.27 Weak
353 NMT-TY0766
T22
 0 -37.843 4.2647 -1.1843 14 22 0.65 0.81 0.53 0.55 Reject
354 MK219
T22
 0 -21.827 4.2682 -0.9704 13 23 0.69 0.86 0.27 0.27 Weak
355 OSA_Lib_33
T22
 0 -17.813 4.2724 -0.8360 6 24 0.50 0.71 0.27 0.27 Reject
356 Z44426251
T22
 0 -28.582 4.2785 -0.9196 7 25 0.53 0.76 0.07 0.09 Reject
357 Z57906434
T22
 0 -35.225 4.2802 -1.4686 14 17 0.73 0.76 0.40 0.45 Weak
358 Z30857952
T22
 0 -29.258 4.2806 -1.4806 13 19 0.54 0.67 0.40 0.36 Weak
359 OHD_Leishmania_402
T22
 0 -24.999 4.2820 -0.8929 7 21 0.75 0.86 0.27 0.27 Weak
360 OHD_MAC_29
T22
 0 -25.758 4.3027 -0.9932 16 25 0.64 0.86 0.20 0.27 Reject
361 Z29466897
T22
 0 -39.039 4.3128 -1.1992 12 15 0.64 0.67 0.40 0.45 Reject
362 OHD_TB2021_34
T22
 0 -32.303 4.3231 -1.6537 13 18 0.50 0.62 0.40 0.45 Weak
363 NMT-TY0615
T22
 0 -25.485 4.3279 -1.0729 16 24 0.61 0.81 0.47 0.45 Reject
364 GemmaOHDUnisi_38
T22
 0 -24.812 4.3491 -1.1227 10 18 0.50 0.62 0.27 0.27 Weak
365 ulfkktlib_588
T22
 0 -29.495 4.3559 -1.3893 10 19 0.38 0.52 0.40 0.36 Weak
366 NMT-TY0371
T22
 1
2 total
 -30.294 4.3598 -1.6566 16 22 0.39 0.57 0.27 0.27 Weak
367 Z49596752
T22
 0 -31.896 4.3601 -1.1200 10 24 0.73 0.90 0.40 0.45 Weak
368 Z19315064
T22
 0 -31.019 4.3752 -1.0662 10 22 0.79 0.90 0.53 0.55 Reject
369 NMT-TY0578
T22
 1
2 total
 -26.968 4.3797 -1.4093 16 20 0.46 0.62 0.20 0.18 Reject
370 Z49605060
T22
 0 -30.966 4.3888 -1.1950 12 24 0.36 0.57 0.40 0.45 Weak
371 Z18285807
T22
 0 -19.571 4.3937 -1.0670 10 18 0.77 0.81 0.47 0.55 Weak
372 KB_Leish_110
T22
 0 -40.532 4.3986 -1.1721 10 19 0.82 0.86 0.40 0.36 Weak
373 ulfkktlib_3920
T22
 0 -29.312 4.4021 -0.9497 6 22 0.48 0.67 0.27 0.27 Reject
374 OSA_Lib_189
T22
 0 -31.706 4.4057 -0.8665 4 24 0.61 0.81 0.20 0.18 Weak
375 NMT-TY0930
T22
 0 -26.741 4.4063 -1.3340 9 22 0.54 0.71 0.47 0.45 Reject
376 Z32301499
T22
 0 -29.853 4.4121 -1.0015 8 23 0.63 0.81 0.40 0.36 Reject
377 NMT-TY0618
T22
 0 -29.219 4.4150 -1.1592 16 21 0.35 0.52 0.33 0.36 Weak
378 TC313
T22
 0 -33.500 4.4153 -1.0970 7 22 0.65 0.81 0.40 0.45 Weak
379 NMT-TY0549
T22
 0 -31.329 4.4186 -1.2144 15 26 0.62 0.86 0.33 0.45 Weak
380 MK44
T22
 0 -28.508 4.4233 -1.0743 6 21 0.91 0.95 0.33 0.36 Reject
381 Z49604831
T22
 0 -34.274 4.4324 -1.2451 12 21 0.75 0.86 0.47 0.55 Reject
382 Z49576055
T22
 0 -34.666 4.4347 -1.4337 13 20 0.86 0.90 0.53 0.55 Reject
383 Z29007297
T22
 0 -34.356 4.4388 -1.1188 12 23 0.69 0.86 0.47 0.55 Weak
384 GemmaOHDUnisi_40
T22
 0 -28.192 4.4425 -1.0351 8 21 0.45 0.62 0.20 0.27 Weak
385 Z815263996
T22
 0 -26.334 4.4472 -0.9289 4 18 0.86 0.86 0.27 0.27 Reject
386 Z25915339
T22
 0 -30.809 4.4523 -0.9955 7 20 0.64 0.76 0.27 0.36 Weak
387 Z30002984
T22
 0 -29.769 4.4571 -0.8931 10 24 0.67 0.86 0.33 0.36 Weak
388 Z30002754
T22
 0 -30.281 4.4633 -0.9164 9 20 0.52 0.67 0.40 0.45 Weak
389 ulfkktlib_2478
T22
 0 -35.159 4.4700 -1.0805 6 19 0.38 0.52 0.33 0.36 Weak
390 Z31546448
T22
 0 -23.300 4.4701 -0.9622 11 24 0.67 0.86 0.33 0.36 Reject
391 KB_chagas_34
T22
 0 -28.731 4.4824 -0.9915 6 25 0.64 0.86 0.20 0.27 Reject
392 Z27745923
T22
 0 -32.193 4.4842 -1.1088 8 23 0.69 0.86 0.40 0.55 Weak
393 Z73416904
T22
 0 -31.424 4.4927 -1.0365 13 23 0.52 0.71 0.33 0.36 Weak
394 Z31907028
T22
 0 -30.853 4.4978 -1.0222 10 17 0.58 0.67 0.47 0.45 Reject
395 Z31819752
T22
 0 -30.194 4.4992 -0.9087 10 26 0.68 0.90 0.40 0.36 Reject
396 Z44866976
T22
 0 -33.920 4.4996 -1.2028 16 22 0.72 0.86 0.73 0.82 Reject
397 KB_HAT_95
T22
 0 -31.043 4.5008 -1.0139 8 19 0.60 0.71 0.40 0.36 Weak
398 Z334929348
T22
 0 -31.433 4.5122 -1.6923 13 20 0.52 0.67 0.33 0.36 Weak
399 Z56821488
T22
 0 -28.695 4.5296 -1.1516 10 21 0.56 0.71 0.47 0.45 Weak
400 Z31681161
T22
 0 -29.538 4.5302 -1.1731 12 23 0.69 0.86 0.60 0.82 Reject
401 KB_HAT_107
T22
 0 -30.598 4.5378 -1.0496 11 21 0.91 0.95 0.47 0.55 Weak
402 TC489
T22
 0 -30.677 4.5435 -0.9173 12 24 0.73 0.90 0.40 0.45 Reject
403 Z1557399790
T22
 0 -28.362 4.5439 -0.7943 16 24 0.61 0.81 0.60 0.64 Reject
404 ulfkktlib_3888
T22
 0 -33.241 4.5523 -1.2273 5 20 0.37 0.52 0.27 0.27 Reject
405 MK155
T22
 0 -27.465 4.5645 -1.0676 12 16 0.68 0.71 0.40 0.45 Weak
406 Z992054036
T22
 0 -28.991 4.5662 -0.9648 10 22 0.79 0.90 0.40 0.36 Weak
407 Z56940452
T22
 0 -31.279 4.5691 -1.0514 11 19 0.48 0.62 0.47 0.55 Weak
408 NMT-TY0977
T22
 0 -29.508 4.5692 -1.4003 8 19 0.48 0.62 0.40 0.36 Weak
409 KB_HAT_112
T22
 0 -32.386 4.5940 -1.0195 11 27 0.66 0.90 0.33 0.45 Reject
410 MK194
T22
 0 -30.718 4.5946 -1.1130 8 18 0.56 0.67 0.33 0.27 Weak
411 TC488
T22
 0 -29.808 4.5959 -0.8905 11 22 0.95 1.00 0.33 0.36 Reject
412 KB_Leish_74
T22
 0 -32.233 4.5976 -1.0207 10 22 0.48 0.67 0.20 0.27 Reject
413 GemmaOHDUnisi_41
T22
 0 -33.709 4.6006 -0.9407 11 24 0.61 0.81 0.27 0.36 Weak
414 NMT-TY0958
T22
 0 -31.280 4.6092 -1.1171 14 27 0.66 0.90 0.53 0.55 Reject
415 Z57300836
T22
 0 -28.175 4.6230 -1.2211 10 18 0.44 0.57 0.40 0.36 Weak
416 KB_chagas_97
T22
 0 -34.069 4.6365 -1.2366 11 22 0.72 0.86 0.47 0.45 Weak
417 NMT-TY0617
T22
 0 -31.546 4.6395 -1.2336 16 21 0.35 0.52 0.40 0.45 Weak
418 KB_chagas_66
T22
 0 -30.534 4.6401 -1.0267 8 26 0.81 1.00 0.27 0.27 Reject
419 Z56789391
T22
 0 -31.648 4.6412 -1.4682 16 19 0.38 0.52 0.40 0.45 Weak
420 TC360
T22
 0 -33.471 4.6467 -1.0820 10 22 0.54 0.71 0.33 0.36 Weak
421 OHD_TB2020_9
T22
 0 -30.853 4.6524 -0.9929 6 22 0.54 0.71 0.33 0.36 Reject
422 Z49597823
T22
 0 -34.339 4.6552 -0.8292 10 18 0.62 0.71 0.47 0.45 Weak
423 OSA_Lib_188
T22
 0 -28.810 4.6567 -0.8139 4 24 0.61 0.81 0.20 0.18 Weak
424 Z44857448
T22
 0 -29.999 4.6581 -1.1308 10 21 0.35 0.52 0.40 0.36 Reject
425 NMT-TY0435
T22
 0 -23.243 4.6583 -1.2161 13 15 0.64 0.67 0.47 0.45 Reject
426 Z56865835
T22
 0 -29.957 4.6925 -0.9518 9 19 0.82 0.86 0.47 0.45 Weak
427 Z56787095
T22
 0 -26.218 4.6939 -0.8114 12 24 0.80 0.95 0.33 0.55 Reject
428 Z30932461
T22
 0 -37.614 4.6972 -1.4959 12 22 0.95 1.00 0.47 0.45 Weak
429 KB_HAT_92
T22
 0 -27.544 4.6983 -0.9380 9 23 0.57 0.76 0.40 0.36 Weak
430 NMT-TY0929
T22
 0 -28.553 4.7055 -1.1784 9 21 0.50 0.67 0.40 0.36 Reject
431 OHD_MAC_36
T22
 0 -25.954 4.7101 -1.0876 15 23 0.83 0.95 0.40 0.45 Reject
432 NMT-TY0837
T22
 0 -26.981 4.7186 -1.5924 16 18 0.34 0.48 0.33 0.27 Weak
433 Z56784490
T22
 0 -33.209 4.7192 -1.0954 7 23 0.47 0.67 0.27 0.36 Reject
434 OHD_TbNat_133
T22
 0 -28.867 4.7268 -1.2377 10 17 0.46 0.57 0.27 0.27 Weak
435 KB_HAT_17
T22
 0 -28.890 4.7278 -1.1643 10 16 0.61 0.67 0.40 0.36 Reject
436 NMT-TY0626
T22
 0 -33.896 4.7293 -1.3203 16 20 0.37 0.52 0.33 0.36 Weak
437 Z18522399
T22
 0 -27.701 4.7424 -1.0030 7 19 0.33 0.48 0.33 0.36 Weak
438 Z56983508
T22
 0 -26.585 4.7430 -0.9890 8 25 0.77 0.95 0.40 0.45 Reject
439 NMT-TY0432
T22
 0 -34.867 4.7519 -1.2603 11 21 0.91 0.95 0.47 0.45 Reject
440 KB_HAT_138
T22
 0 -29.111 4.7542 -1.0520 10 21 0.91 0.95 0.53 0.64 Weak
441 Z193095380
T22
 0 -32.375 4.7547 -1.3693 11 21 0.50 0.67 0.47 0.45 Weak
442 Z45452525
T22
 0 -30.876 4.7729 -0.9893 8 22 0.43 0.62 0.33 0.36 Reject
443 Z49724748
T22
 0 -34.360 4.7740 -1.4217 11 23 0.91 1.00 0.33 0.36 Reject
444 Z30004986
T22
 0 -30.290 4.7900 -1.2452 8 24 0.61 0.81 0.47 0.45 Reject
445 Z68348244
T22
 0 -36.306 4.8031 -1.2771 6 23 0.52 0.71 0.33 0.36 Reject
446 Z56566324
T22
 0 -41.573 4.8128 -1.2057 12 17 0.41 0.52 0.40 0.36 Reject
447 Z31477806
T22
 0 -29.354 4.8200 -1.5284 13 18 0.70 0.76 0.47 0.45 Weak
448 OHD_MAC_18
T22
 0 -24.877 4.8230 -0.9315 13 18 0.56 0.67 0.27 0.27 Reject
449 Z79567126
T22
 0 -30.181 4.8260 -0.9761 9 23 0.76 0.90 0.20 0.18 Weak
450 Z1213738863
T22
 0 -26.357 4.8263 -0.8188 9 20 0.64 0.76 0.33 0.36 Reject
451 Z68347496
T22
 0 -35.192 4.8277 -1.3661 12 19 0.82 0.86 0.60 0.64 Reject
452 Z27739534
T22
 0 -28.196 4.8279 -1.1300 13 16 0.68 0.71 0.47 0.45 Reject
453 KB_Leish_32
T22
 0 -30.112 4.8370 -0.9237 10 18 0.62 0.71 0.47 0.45 Weak
454 NMT-TY0975
T22
 0 -28.085 4.8386 -1.3115 9 18 0.44 0.57 0.53 0.55 Weak
455 Z56782920
T22
 0 -26.034 4.8398 -1.1863 9 19 0.54 0.67 0.40 0.45 Weak
456 Z49613256
T22
 0 -34.279 4.8440 -1.4757 16 18 0.39 0.52 0.40 0.36 Weak
457 OHD_Leishmania_29
T22
 0 -33.060 4.9115 -1.1713 12 23 0.83 0.95 0.60 0.64 Reject
458 Z49576315
T22
 0 -32.224 4.9136 -1.3388 14 21 0.91 0.95 0.60 0.55 Reject
459 Z30621155
T22
 0 -28.651 4.9409 -1.2103 8 24 0.80 0.95 0.40 0.45 Reject
460 Z45612920
T22
 0 -29.029 4.9446 -1.0772 7 18 0.50 0.62 0.33 0.36 Weak
461 OHD_TB2020_44
T22
 0 -28.246 4.9460 -0.8224 9 22 0.65 0.81 0.33 0.27 Reject
462 Z44856623
T22
 0 -33.687 4.9630 -1.0971 11 25 0.77 0.95 0.47 0.45 Reject
463 ulfkktlib_2489
T22
 0 -29.101 4.9798 -0.8786 12 18 0.44 0.57 0.47 0.45 Weak
464 NMT-TY0540
T22
 0 -23.345 4.9904 -1.3707 16 21 0.35 0.52 0.27 0.27 Reject
465 Z55668625
T22
 0 -31.254 4.9960 -0.9665 11 20 0.64 0.76 0.53 0.64 Reject
466 MK174
T22
 0 -31.210 4.9962 -1.0466 8 20 0.58 0.71 0.33 0.36 Weak
467 MK16
T22
 0 -27.133 4.9996 -1.0902 11 22 0.79 0.90 0.27 0.36 Weak
468 NMT-TY0563
T22
 0 -29.976 5.0062 -1.3521 16 19 0.43 0.57 0.40 0.36 Weak
469 OHD_TC1_161
T22
 0 -29.278 5.0165 -1.2292 16 21 0.35 0.52 0.33 0.36 Weak
470 KB_Leish_147
T22
 0 -25.356 5.0172 -1.0759 10 20 0.52 0.67 0.40 0.36 Reject
471 NMT-TY0403
T22
 0 -27.078 5.0398 -1.3740 16 19 0.38 0.52 0.40 0.36 Reject
472 Z1541758605
T22
 0 -29.399 5.0631 -0.9193 10 22 0.79 0.90 0.40 0.45 Reject
473 KB_HAT_24
T22
 0 -30.870 5.0777 -0.9592 8 20 0.52 0.67 0.33 0.36 Weak
474 Z27664401
T22
 0 -29.906 5.0823 -0.9121 8 21 0.62 0.76 0.33 0.36 Weak
475 TC419
T22
 0 -31.713 5.0887 -0.8589 14 27 0.60 0.86 0.27 0.27 Reject
476 Z31204085
T22
 0 -31.090 5.0890 -1.0184 11 23 0.52 0.71 0.33 0.36 Reject
477 KB_HAT_71
T22
 0 -26.524 5.0946 -0.9109 4 26 0.62 0.86 0.20 0.27 Reject
478 Z31453186
T22
 0 -30.050 5.0960 -1.0528 7 24 0.55 0.76 0.33 0.36 Weak
479 Z57907181
T22
 0 -25.751 5.0968 -0.8838 11 22 0.72 0.86 0.27 0.27 Weak
480 Z49576389
T22
 0 -33.735 5.1085 -1.1091 14 21 0.91 0.95 0.60 0.55 Reject
481 OSA_Lib_78
T22
 0 -25.560 5.1102 -0.8126 9 22 0.59 0.76 0.20 0.18 Reject
482 NMT-TY0433
T22
 0 -34.384 5.1245 -1.1903 10 21 0.91 0.95 0.47 0.45 Reject
483 Z49620424
T22
 0 -33.976 5.1306 -1.3476 10 22 0.59 0.76 0.33 0.36 Weak
484 Z49604116
T22
 0 -25.620 5.1395 -1.1416 16 23 0.47 0.67 0.47 0.55 Reject
485 OHD_TB2023_29
T22
 1
2 total
 -34.438 5.1418 -1.1388 10 19 0.33 0.48 0.33 0.36 Reject
486 Z57176222
T22
 0 -30.079 5.1522 -1.4452 11 18 0.62 0.71 0.27 0.36 Weak
487 MK24
T22
 0 -31.652 5.1526 -0.8940 8 16 0.76 0.76 0.40 0.55 Reject
488 NMT-TY0957
T22
 0 -29.035 5.1573 -1.1188 13 26 0.68 0.90 0.33 0.45 Reject
489 NMT-TY0941
T22
 0 -30.596 5.2156 -1.2184 16 19 0.33 0.48 0.40 0.36 Weak
490 NMT-TY0404
T22
 0 -29.030 5.2378 -1.6345 12 17 0.46 0.57 0.47 0.45 Weak
491 Z20215696
T22
 0 -28.091 5.2481 -0.9844 12 17 0.73 0.76 0.40 0.45 Reject
492 NMT-TY0976
T22
 0 -31.933 5.2793 -1.2983 9 22 0.65 0.81 0.40 0.45 Reject
493 Z31786514
T22
 0 -30.928 5.2851 -1.0366 7 24 0.55 0.76 0.13 0.18 Reject
494 NMT-TY0607
T22
 0 -29.885 5.3708 -1.3136 16 21 0.35 0.52 0.40 0.45 Weak
495 TC325
T22
 0 -30.374 5.3882 -1.5669 11 22 0.87 0.95 0.47 0.45 Weak
496 OHD_TC1_243
T22
 0 -26.870 5.3883 -0.6426 7 23 0.52 0.71 0.00 0.00 Reject
497 KB_HAT_171
T22
 0 -26.218 5.4096 -0.9375 8 19 0.54 0.67 0.40 0.45 Reject
498 OHD_Leishmania_403
T22
 0 -26.086 5.4159 -0.8839 8 22 0.79 0.90 0.33 0.45 Weak
499 OHD_MAC_77
T22
 0 -22.934 5.4338 -1.0297 14 19 0.67 0.76 0.33 0.45 Reject
500 Z44847963
T22
 0 -30.875 5.4441 -1.0697 11 29 0.67 0.95 0.33 0.27 Weak
501 MK220
T22
 0 -29.939 5.4953 -0.9681 9 25 0.84 1.00 0.33 0.36 Weak
502 Z92413403
T22
 0 -25.805 5.4970 -1.0693 12 23 0.83 0.95 0.53 0.55 Weak
503 Z44848695
T22
 0 -36.860 5.5065 -1.0579 15 25 0.64 0.86 0.33 0.36 Reject
504 Z56784505
T22
 0 -29.545 5.5382 -0.9931 9 22 0.43 0.62 0.40 0.45 Weak
505 Z27521484
T22
 0 -31.490 5.5556 -1.0693 6 20 0.71 0.81 0.27 0.27 Weak
506 Z32359515
T22
 0 -29.511 5.5687 -0.9907 10 18 0.77 0.81 0.40 0.36 Weak
507 OSA_Lib_96
T22
 0 -20.288 5.5756 -0.9359 6 22 0.48 0.67 0.27 0.27 Reject
508 OHD_Leishmania_16
T22
 0 -31.843 5.5857 -1.3754 12 14 0.46 0.52 0.40 0.45 Reject
509 Z55694322
T22
 0 -33.859 5.6052 -1.1125 9 20 0.78 0.86 0.47 0.45 Reject
510 OHD_TB2021_74
T22
 0 -33.212 5.6162 -0.7911 8 24 0.61 0.81 0.40 0.45 Weak
511 Z32377576
T22
 0 -38.329 5.6257 -1.4671 11 23 0.91 1.00 0.40 0.36 Weak
512 NMT-TY0567
T22
 0 -32.242 5.6559 -1.2655 15 18 0.62 0.71 0.40 0.36 Weak
513 NMT-TY0968
T22
 0 -30.246 5.6756 -1.1350 12 24 0.61 0.81 0.47 0.45 Reject
514 TC343
T22
 0 -28.946 5.6881 -0.9049 16 25 0.59 0.81 0.27 0.27 Reject
515 OSA_Lib_193
T22
 0 -22.596 5.7086 -0.9012 5 23 0.52 0.71 0.20 0.18 Weak
516 MK154
T22
 0 -27.141 5.7393 -0.9917 12 26 0.62 0.86 0.33 0.36 Reject
517 OHD_MAC_51
T22
 0 -21.205 5.7481 -0.9295 16 25 0.77 0.95 0.33 0.36 Reject
518 Z56773008
T22
 0 -38.070 5.7517 -1.1757 12 22 0.43 0.62 0.33 0.27 Weak
519 OHD_TC1_194
T22
 0 -33.839 5.8104 -0.8286 9 20 0.37 0.52 0.40 0.36 Reject
520 NMT-TY0602
T22
 0 -31.810 5.8255 -1.3346 16 21 0.40 0.57 0.40 0.36 Weak
521 ulfkktlib_1030
T22
 0 -32.415 5.8878 -1.7587 16 16 0.42 0.52 0.40 0.45 Weak
522 Z30932232
T22
 0 -33.976 5.9101 -1.7324 13 16 0.54 0.62 0.47 0.45 Weak
523 Z44848907
T22
 0 -28.264 5.9797 -0.8515 7 26 0.74 0.95 0.13 0.18 Reject
524 KB_HAT_96
T22
 0 -28.882 6.2231 -1.0244 9 22 0.39 0.57 0.33 0.36 Weak
525 MK47
T22
 0 -23.833 6.3559 -1.3029 16 18 0.34 0.48 0.33 0.36 Reject
526 NMT-TY0971
T22
 0 -30.588 6.4402 -1.0849 10 24 0.61 0.81 0.47 0.45 Reject
527 OHD_TB2022_14
T22
 0 -25.474 6.5275 -0.7417 11 24 0.67 0.86 0.47 0.45 Reject
528 Z13702152
T22
 0 -23.826 6.6148 -0.9405 10 21 0.40 0.57 0.40 0.36 Reject
529 NMT-TY0972
T22
 0 -25.991 6.7429 -0.9778 10 26 0.74 0.95 0.40 0.36 Reject
530 OHD_Leishmania_45
T22
 0 -29.090 6.9197 -0.5673 16 23 0.57 0.76 0.40 0.55 Reject
531 NMT-TY0518
T22
 0 -26.411 7.2836 -0.9124 12 15 0.57 0.62 0.40 0.36 Reject
532 OHD_Babesia_24
T22
 0 -24.266 7.6986 -0.8041 15 24 0.61 0.81 0.33 0.36 Reject
533 Z57457889
T22
 0 -29.194 7.7386 -1.0248 16 22 0.54 0.71 0.33 0.36 Weak
534 RAB5A
T22
 0 - - - 16 21 1.00 1.00 1.00 1.00 Reject

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